In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 1-[methyl-[[(2S)-tetrahydrofuran-2-yl]methyl]amino]-3-phenyl-propan-2-one 1-[methyl-[[(2S)-tetrahydrofuran…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.69 | 8.4 | -41.35 | 1 | 3 | 1 | 31 | 248.346 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 6.05 | -10.09 | 0 | 3 | 0 | 30 | 247.338 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.